2-[3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[3-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[3-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidino]propanoylamino]thiophene-3-carboxamide Formula: C20H21ClN4O2S2 MolecularWeight: 448.98934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)Cl)CCC(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)Cl)CCC(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C20H21ClN4O2S2/c21-13-1-2-16-15(11-13)23-19(29-16)12-3-7-25(8-4-12)9-5-17(26)24-20-14(18(22)27)6-10-28-20/h1-2,6,10-12H,3-5,7-9H2,(H2,22,27)(H,24,26)